866131-64-8
Product Name:
7-[(2,2,2-TRIFLUOROACETYL)AMINO]-6,7-DIHYDRO-5H-INDENO[5,6-D][1,3]DIOXOL-5-YL 2-THIOPHENECARBOXYLATE
Formula:
C17H12F3NO5S
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COMPUTED DESCRIPTORS
| Molecular Weight | 399.3 g/mol |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 4 |
| Exact Mass | 399.03882814 g/mol |
| Monoisotopic Mass | 399.03882814 g/mol |
| Topological Polar Surface Area | 102 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 604 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |